SCHEMBL29623202

SCHEMBL29623202

O=c1c2cc(Cl)ccc2nc(Nc2ccc(CN3CCCCC3)cc2)n1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 5/20 0.52
ACHE P22303 1/20 0.43
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
AVPR1B P47901 1/20 0.41
MAP3K7 O43318 2/20 0.41
IRAK1 P51617 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23065072 1.00 ACP1 (0.52) ACP1ACHEMEN1ALDH1A1KMT2A
SCHEMBL23065073 0.97 ACP1 (0.48) ACP1ACHEAVPR1B
SCHEMBL29623222 0.90 KMT2A (0.47) ACP1MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL24089977 0.90 KMT2A (0.47) ACP1MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL23065098 0.89 MEN1 (0.52) ACP1ACHEMEN1ALDH1A1KMT2A
SCHEMBL29623188 0.89 MEN1 (0.52) ACP1ACHEMEN1ALDH1A1KMT2A
SCHEMBL24090101 0.89 ACP1 (0.51) ACP1ALDH1A1AVPR1B
SCHEMBL24407885 0.88 ACP1 (0.42) ACP1MEN1ALDH1A1KMT2AKDM4E
SCHEMBL23045336 0.87 ACP1 (0.40) ACP1
SCHEMBL23045335 0.87 NPC1 (0.40) ACP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN claimed
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN disclosed